==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-MAR-99 1QAN . COMPND 2 MOLECULE: ERMC' METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR G.SCHLUCKEBIER,P.ZHONG,K. D.STEWART,T. J.KAVANAUGH,C.ABAD- . 237 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12641.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 76.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 27 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 2 0 1 3 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 9 A S 0 0 91 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-174.6 22.9 34.9 20.0 2 10 A Q + 0 0 73 92,-0.0 2,-0.7 2,-0.0 92,-0.1 -0.824 360.0 164.3-132.8 93.4 20.1 37.5 19.9 3 11 A N - 0 0 42 -2,-0.4 2,-0.1 90,-0.1 155,-0.0 -0.898 21.0-162.1-113.1 101.1 17.6 37.1 17.1 4 12 A F E -A 156 0A 20 152,-1.7 152,-1.3 -2,-0.7 2,-0.6 -0.445 17.4-146.6 -84.1 152.4 14.5 39.2 17.8 5 13 A I E +A 155 0A 0 233,-2.3 150,-0.2 150,-0.2 149,-0.1 -0.963 32.3 160.5-115.9 105.5 11.1 38.8 16.2 6 14 A T + 0 0 73 -2,-0.6 2,-0.8 148,-0.5 -1,-0.1 0.456 29.4 108.6-112.2 -1.6 9.8 42.4 16.0 7 15 A S >> - 0 0 50 147,-0.4 4,-2.5 1,-0.2 3,-1.0 -0.679 55.7-151.8 -81.6 115.0 7.0 42.6 13.5 8 16 A K H 3> S+ 0 0 108 -2,-0.8 4,-2.3 1,-0.3 -1,-0.2 0.871 97.9 57.3 -48.0 -41.1 3.7 43.0 15.3 9 17 A H H 3> S+ 0 0 120 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.867 110.5 41.6 -58.3 -42.1 2.1 41.3 12.4 10 18 A N H <> S+ 0 0 25 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.824 109.4 58.4 -76.2 -34.3 4.2 38.2 12.9 11 19 A I H X S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.915 105.6 50.6 -61.0 -43.7 4.0 38.2 16.6 12 20 A D H X S+ 0 0 64 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.885 107.8 52.7 -63.2 -40.0 0.2 38.0 16.3 13 21 A K H X S+ 0 0 97 -4,-1.2 4,-0.5 2,-0.2 3,-0.3 0.944 112.4 44.4 -60.1 -49.1 0.4 35.0 14.0 14 22 A I H >X S+ 0 0 6 -4,-2.2 3,-1.6 1,-0.2 4,-0.6 0.910 109.6 54.9 -61.9 -44.6 2.7 33.1 16.4 15 23 A M H >< S+ 0 0 5 -4,-2.7 3,-0.7 1,-0.3 -1,-0.2 0.780 93.9 74.3 -60.5 -24.8 0.5 34.0 19.4 16 24 A T H 3< S+ 0 0 95 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.863 99.4 42.4 -56.3 -35.9 -2.3 32.5 17.5 17 25 A N H << S+ 0 0 37 -3,-1.6 2,-0.9 -4,-0.5 -1,-0.2 0.608 95.8 88.8 -87.9 -12.1 -0.9 29.1 18.2 18 26 A I << - 0 0 0 -3,-0.7 2,-1.3 -4,-0.6 -1,-0.1 -0.759 58.6-167.3 -91.7 104.9 -0.1 29.8 21.9 19 27 A R + 0 0 158 -2,-0.9 2,-0.3 2,-0.0 -1,-0.1 -0.465 30.6 144.2 -92.4 66.0 -3.1 29.0 24.0 20 28 A L - 0 0 7 -2,-1.3 2,-0.2 4,-0.0 -2,-0.0 -0.759 35.5-145.9 -96.2 147.3 -2.1 30.6 27.3 21 29 A N > - 0 0 68 -2,-0.3 3,-2.1 1,-0.0 24,-0.6 -0.725 26.6 -94.7-118.0 169.9 -5.0 32.1 29.3 22 30 A E T 3 S+ 0 0 127 1,-0.3 22,-0.1 22,-0.2 -1,-0.0 0.604 118.9 50.7 -48.6 -23.0 -5.6 35.1 31.6 23 31 A H T 3 S+ 0 0 123 21,-0.1 2,-0.3 22,-0.1 -1,-0.3 0.472 85.4 105.2-100.2 -3.3 -5.1 33.0 34.8 24 32 A D < - 0 0 26 -3,-2.1 21,-1.3 19,-0.2 22,-1.1 -0.599 62.4-140.9 -82.1 137.4 -1.7 31.4 34.0 25 33 A N E -b 46 0B 43 62,-0.4 64,-2.3 -2,-0.3 2,-0.4 -0.810 28.1-155.5 -92.7 133.6 1.5 32.7 35.6 26 34 A I E -bc 47 89B 2 20,-3.3 22,-3.3 -2,-0.4 2,-0.6 -0.909 22.7-161.2-122.5 142.7 4.3 32.7 33.0 27 35 A F E -bc 48 90B 13 62,-1.9 64,-1.9 -2,-0.4 2,-0.5 -0.976 19.0-158.4-113.5 118.4 8.1 32.6 33.0 28 36 A E E -bc 49 91B 0 20,-2.0 22,-2.9 -2,-0.6 2,-0.7 -0.867 9.6-140.9-100.4 132.1 9.5 33.9 29.7 29 37 A I E S-bc 50 92B 4 62,-2.4 64,-0.7 -2,-0.5 22,-0.1 -0.818 81.3 -4.5 -91.6 112.6 13.1 32.8 28.8 30 38 A G - 0 0 1 20,-2.9 63,-0.3 -2,-0.7 -1,-0.2 0.997 62.3-167.6 71.7 73.9 14.9 35.7 27.2 31 39 A S > + 0 0 0 -3,-0.3 3,-2.4 19,-0.2 6,-0.4 0.750 21.3 178.7 -63.9 -22.5 12.5 38.6 26.9 32 40 A G T 3 S- 0 0 0 1,-0.3 28,-0.4 206,-0.3 -1,-0.2 -0.359 70.4 -9.4 59.6-120.5 14.9 40.4 24.7 33 41 A K T 3 S- 0 0 92 -2,-0.2 -1,-0.3 -3,-0.1 30,-0.1 0.264 103.9-104.9 -93.8 12.6 13.4 43.7 23.6 34 42 A G S <> S+ 0 0 0 -3,-2.4 4,-2.2 -4,-0.1 5,-0.2 0.505 77.2 133.4 81.8 9.7 10.1 42.8 25.1 35 43 A H H > S+ 0 0 32 -4,-0.3 4,-0.6 1,-0.2 -3,-0.1 0.880 84.5 29.7 -61.4 -42.3 8.0 42.0 21.9 36 44 A F H >> S+ 0 0 0 -5,-0.4 4,-2.3 2,-0.2 3,-0.6 0.841 115.5 63.0 -83.1 -34.2 6.5 38.7 23.2 37 45 A T H 3> S+ 0 0 0 -6,-0.4 4,-1.9 1,-0.3 -2,-0.2 0.851 99.0 55.2 -56.4 -37.1 6.6 39.9 26.8 38 46 A L H 3X S+ 0 0 28 -4,-2.2 4,-0.7 1,-0.2 -1,-0.3 0.848 110.9 43.9 -66.1 -35.0 4.2 42.7 25.9 39 47 A E H - 0 0 48 1,-0.2 4,-1.6 22,-0.1 3,-0.1 -0.502 69.5-153.7 -70.2 104.4 21.5 40.8 29.1 54 62 A H H > S+ 0 0 143 -2,-0.8 4,-0.9 1,-0.2 -1,-0.2 0.835 92.4 49.9 -44.5 -44.1 21.4 43.5 31.7 55 63 A K H >> S+ 0 0 134 1,-0.2 4,-2.0 2,-0.2 3,-1.1 0.940 106.0 54.3 -64.1 -49.9 20.5 46.2 29.0 56 64 A L H 3> S+ 0 0 7 1,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.777 99.3 63.1 -57.4 -28.8 17.7 44.2 27.4 57 65 A C H 3X S+ 0 0 8 -4,-1.6 4,-2.3 2,-0.2 -1,-0.3 0.906 106.4 45.3 -63.0 -37.5 16.0 43.9 30.9 58 66 A K H < S+ 0 0 90 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.919 107.9 51.8 -61.4 -42.4 10.4 50.3 29.0 63 71 A K H 3< S+ 0 0 81 -4,-2.5 3,-0.3 1,-0.3 -1,-0.2 0.803 108.9 52.4 -65.9 -23.3 8.2 48.4 26.6 64 72 A L T >< S+ 0 0 2 -4,-1.4 3,-2.1 -3,-0.4 -1,-0.3 0.120 70.5 124.8-100.5 22.0 6.0 47.3 29.5 65 73 A V T < S+ 0 0 113 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.859 72.3 49.6 -45.4 -50.8 5.5 50.8 30.9 66 74 A D T 3 S+ 0 0 133 -3,-0.3 2,-0.3 -4,-0.2 -1,-0.3 0.169 102.6 78.0 -80.8 19.7 1.7 50.5 30.9 67 75 A H < - 0 0 47 -3,-2.1 3,-0.1 1,-0.1 -25,-0.1 -0.954 45.5-178.8-134.1 151.1 1.5 47.2 32.6 68 76 A D + 0 0 151 -2,-0.3 2,-2.5 -27,-0.1 -1,-0.1 0.696 61.9 88.9-117.0 -26.5 1.9 45.9 36.2 69 77 A N S S+ 0 0 42 -28,-0.1 -22,-1.9 -25,-0.1 2,-0.3 -0.245 84.4 57.0 -75.6 56.3 1.5 42.1 36.1 70 78 A F E -d 47 0B 37 -2,-2.5 2,-0.3 -24,-0.2 -22,-0.2 -0.958 53.7-157.8-164.1-179.7 5.2 41.3 35.6 71 79 A Q E -d 48 0B 85 -24,-1.4 -22,-2.4 -2,-0.3 2,-0.5 -0.929 18.1-135.9-163.4 154.3 8.8 41.7 36.8 72 80 A V E -d 49 0B 19 -2,-0.3 2,-0.5 -24,-0.2 -22,-0.2 -0.962 16.4-164.9-126.6 115.8 12.1 41.4 34.9 73 81 A L E -d 50 0B 50 -24,-2.6 -22,-2.6 -2,-0.5 2,-1.5 -0.853 17.2-143.0-103.9 130.6 14.9 39.4 36.5 74 82 A N + 0 0 73 -2,-0.5 2,-0.3 -24,-0.2 -22,-0.2 -0.656 57.3 124.6 -90.3 79.1 18.4 39.8 35.2 75 83 A K - 0 0 119 -2,-1.5 2,-0.6 -24,-0.1 3,-0.1 -0.803 67.2-103.1-131.0 171.8 19.4 36.1 35.7 76 84 A D >> - 0 0 49 -2,-0.3 3,-2.9 1,-0.2 4,-0.7 -0.897 23.9-143.5-100.2 117.1 20.8 33.2 33.7 77 85 A I G >4 S+ 0 0 12 -2,-0.6 3,-1.2 1,-0.3 -1,-0.2 0.859 101.3 62.4 -47.1 -39.0 18.0 30.7 32.9 78 86 A L G 34 S+ 0 0 45 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.739 111.5 35.5 -61.6 -22.5 20.6 28.0 33.4 79 87 A Q G <4 S+ 0 0 141 -3,-2.9 -1,-0.3 2,-0.0 -2,-0.2 0.315 92.8 121.5-112.3 6.8 21.1 29.0 37.0 80 88 A F << - 0 0 26 -3,-1.2 2,-0.6 -4,-0.7 -3,-0.0 -0.421 54.1-142.6 -76.0 145.8 17.5 30.0 37.7 81 89 A K - 0 0 192 -2,-0.1 29,-0.1 29,-0.0 3,-0.1 -0.905 18.6-152.0-113.4 107.3 15.4 28.3 40.5 82 90 A F - 0 0 16 -2,-0.6 -55,-0.0 27,-0.5 24,-0.0 -0.323 28.4 -88.9 -74.6 154.6 11.8 27.7 39.6 83 91 A P - 0 0 37 0, 0.0 28,-0.5 0, 0.0 -1,-0.1 -0.224 30.5-163.2 -60.0 152.0 8.8 27.6 42.0 84 92 A K S S+ 0 0 159 1,-0.1 -2,-0.0 26,-0.1 26,-0.0 0.555 83.1 43.0-113.0 -16.0 8.1 24.1 43.4 85 93 A N S S+ 0 0 166 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.315 99.5 82.8-125.4 51.0 4.6 24.6 44.7 86 94 A Q S S- 0 0 78 -3,-0.1 2,-0.5 2,-0.1 25,-0.1 -0.995 71.8-120.6-152.0 152.7 2.9 26.6 42.0 87 95 A S + 0 0 107 -2,-0.3 -62,-0.4 25,-0.1 2,-0.3 -0.859 48.2 147.1 -96.7 125.6 1.2 26.2 38.7 88 96 A Y - 0 0 3 -2,-0.5 25,-1.6 23,-0.3 26,-0.5 -0.984 32.3-145.5-154.4 157.7 3.0 28.0 35.9 89 97 A K E -ce 26 114B 22 -64,-2.3 -62,-1.9 -2,-0.3 2,-0.4 -0.819 17.7-130.9-123.6 163.4 3.7 27.7 32.2 90 98 A I E +ce 27 115B 0 24,-2.6 26,-3.7 -2,-0.3 2,-0.3 -0.934 18.2 179.7-125.7 141.9 6.7 28.7 30.1 91 99 A F E +ce 28 116B 0 -64,-1.9 -62,-2.4 -2,-0.4 2,-0.2 -0.973 14.4 157.6-131.1 150.2 7.3 30.6 26.9 92 100 A G E -ce 29 117B 0 24,-1.3 26,-2.3 -2,-0.3 2,-0.9 -0.786 39.2-151.2-179.0 132.8 10.6 31.4 25.1 93 101 A N E - e 0 118B 6 -64,-0.7 26,-0.1 -63,-0.3 -90,-0.1 -0.891 49.2-164.7-100.4 97.4 12.2 32.3 21.9 94 102 A I - 0 0 14 24,-1.3 5,-0.1 -2,-0.9 2,-0.1 -0.585 23.4-105.3-102.8 155.9 15.6 30.7 22.7 95 103 A P > - 0 0 6 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 -0.397 25.5-137.7 -67.3 140.5 19.2 30.7 21.4 96 104 A Y G > S+ 0 0 125 1,-0.2 3,-1.8 2,-0.2 4,-0.5 0.900 95.7 67.0 -67.9 -44.5 20.2 27.5 19.5 97 105 A N G 3 S+ 0 0 107 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.689 116.6 25.8 -52.5 -22.9 23.6 27.1 21.1 98 106 A I G <> S+ 0 0 37 -3,-0.6 4,-2.8 2,-0.1 -1,-0.3 0.142 84.0 113.9-129.3 20.5 22.0 26.3 24.5 99 107 A S H <> S+ 0 0 0 -3,-1.8 4,-3.4 2,-0.2 5,-0.3 0.937 80.8 50.6 -56.8 -47.9 18.6 24.9 23.5 100 108 A T H > S+ 0 0 59 -4,-0.5 4,-2.9 1,-0.2 5,-0.3 0.959 112.3 45.8 -54.3 -54.6 19.5 21.5 24.8 101 109 A D H > S+ 0 0 84 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.875 114.8 49.4 -56.9 -40.2 20.7 22.9 28.1 102 110 A I H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.931 111.9 45.7 -66.9 -48.4 17.5 25.1 28.3 103 111 A I H X S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.2 5,-0.4 0.933 113.9 49.1 -62.4 -43.2 15.1 22.3 27.5 104 112 A R H X S+ 0 0 92 -4,-2.9 4,-2.3 -5,-0.3 5,-0.5 0.907 112.3 50.4 -61.3 -39.8 16.8 19.9 30.0 105 113 A K H X S+ 0 0 28 -4,-2.0 4,-1.2 -5,-0.3 -1,-0.2 0.892 115.9 39.3 -65.0 -42.9 16.7 22.7 32.6 106 114 A I H < S+ 0 0 0 -4,-2.5 6,-0.4 2,-0.2 -2,-0.2 0.758 121.4 42.0 -84.0 -22.3 13.0 23.5 32.2 107 115 A V H < S+ 0 0 1 -4,-2.3 3,-0.2 -5,-0.2 -2,-0.2 0.877 129.0 26.3 -88.4 -40.6 11.8 19.9 31.8 108 116 A F H < S+ 0 0 77 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.2 0.676 129.2 39.3 -96.6 -17.3 13.9 18.3 34.5 109 117 A D S < S+ 0 0 82 -4,-1.2 -27,-0.5 -5,-0.5 2,-0.3 -0.024 113.8 46.2-124.7 34.0 14.5 21.2 36.8 110 118 A S - 0 0 10 -3,-0.2 -26,-0.1 -4,-0.2 -29,-0.0 -0.938 68.0-135.8-158.2 164.0 11.1 23.0 36.8 111 119 A I + 0 0 80 -28,-0.5 -23,-0.3 -2,-0.3 -4,-0.1 0.033 44.7 150.4-118.6 28.3 7.5 21.8 37.1 112 120 A A - 0 0 1 -6,-0.4 -23,-0.2 1,-0.2 3,-0.1 -0.359 35.9-154.0 -57.6 131.1 6.0 23.9 34.4 113 121 A D S S+ 0 0 72 -25,-1.6 57,-2.7 1,-0.2 2,-0.4 0.731 77.7 30.2 -86.0 -17.7 3.1 21.9 33.1 114 122 A E E -eF 89 169B 24 -26,-0.5 -24,-2.6 55,-0.2 2,-0.4 -0.982 67.7-171.6-144.5 128.7 3.1 23.5 29.7 115 123 A I E -eF 90 168B 2 53,-2.8 53,-2.9 -2,-0.4 2,-0.5 -0.976 5.9-166.5-128.3 126.1 6.1 24.9 27.7 116 124 A Y E +eF 91 167B 2 -26,-3.7 -24,-1.3 -2,-0.4 2,-0.3 -0.940 18.3 174.1-111.0 121.1 6.1 26.9 24.5 117 125 A L E -eF 92 166B 0 49,-2.1 49,-3.0 -2,-0.5 2,-0.6 -0.963 29.6-147.2-131.6 146.2 9.4 27.3 22.7 118 126 A I E +eF 93 165B 1 -26,-2.3 -24,-1.3 -2,-0.3 2,-0.3 -0.954 39.7 158.3-108.4 115.5 10.7 28.7 19.4 119 127 A V E - F 0 164B 2 45,-2.3 45,-3.3 -2,-0.6 31,-0.2 -0.861 47.9 -68.4-133.5 169.2 13.7 26.6 18.3 120 128 A E E > - 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0 0 42 18,-2.8 2,-0.3 -2,-0.7 19,-0.2 0.851 53.2 -25.8 -85.5 -39.8 2.9 23.5 16.2 148 156 A S E -G 165 0B 33 17,-1.2 17,-2.9 2,-0.0 2,-0.4 -0.988 59.7 -96.6-168.6 166.8 4.1 25.6 13.3 149 157 A M E -G 164 0B 86 -2,-0.3 15,-0.3 15,-0.2 -3,-0.0 -0.764 25.2-153.4 -96.7 135.8 7.0 26.8 11.3 150 158 A V E -G 163 0B 1 13,-3.0 13,-2.4 -2,-0.4 -29,-0.1 -0.914 23.1-128.7-110.6 107.0 8.5 30.3 12.0 151 159 A P > - 0 0 25 0, 0.0 3,-2.5 0, 0.0 4,-0.4 -0.235 11.6-126.9 -56.7 135.8 10.2 31.7 8.8 152 160 A R G > S+ 0 0 83 1,-0.3 3,-1.2 2,-0.2 9,-0.1 0.732 107.6 68.8 -54.8 -24.2 13.8 32.8 9.3 153 161 A E G 3 S+ 0 0 124 1,-0.3 -1,-0.3 5,-0.1 5,-0.1 0.667 86.9 66.9 -70.7 -15.3 12.7 36.2 7.8 154 162 A Y G < S+ 0 0 50 -3,-2.5 -148,-0.5 -149,-0.1 -147,-0.4 0.676 96.4 72.9 -75.0 -20.3 10.7 36.9 10.9 155 163 A F E < S-A 5 0A 12 -3,-1.2 -150,-0.2 -4,-0.4 3,-0.1 -0.612 78.3-128.7 -96.4 157.3 14.0 37.0 12.8 156 164 A H E S+A 4 0A 133 -152,-1.3 -152,-1.7 1,-0.3 2,-0.2 -0.886 101.4 35.2-154.8 119.9 16.7 39.7 12.8 157 165 A P S S- 0 0 73 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 0.486 110.9-123.2 -55.9 145.0 19.6 39.1 12.3 158 166 A K - 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0 0 52 -30,-1.7 2,-0.5 -31,-0.1 3,-0.1 -0.894 47.1 -67.3-144.9 170.8 2.3 14.2 32.0 172 180 A K - 0 0 193 -2,-0.3 -30,-0.0 1,-0.1 0, 0.0 -0.546 69.8-105.3 -64.6 118.0 2.5 11.5 34.7 173 181 A S - 0 0 42 -2,-0.5 -32,-0.2 1,-0.2 -1,-0.1 -0.137 20.5-151.6 -48.5 135.4 6.1 10.3 34.3 174 182 A R S S+ 0 0 113 -34,-1.8 2,-0.6 1,-0.1 -1,-0.2 0.589 83.5 65.5 -85.1 -11.5 6.4 7.0 32.5 175 183 A I S S- 0 0 17 -35,-0.5 -1,-0.1 2,-0.0 -2,-0.1 -0.935 85.0-131.9-117.1 114.8 9.7 6.3 34.5 176 184 A S > - 0 0 44 -2,-0.6 3,-1.6 1,-0.1 4,-0.3 -0.243 24.7-114.0 -59.8 149.6 9.5 5.9 38.3 177 185 A H G > S+ 0 0 153 1,-0.3 3,-0.7 2,-0.2 4,-0.2 0.752 116.8 58.1 -57.0 -25.0 12.0 7.9 40.3 178 186 A K G 3 S+ 0 0 151 1,-0.2 4,-0.3 2,-0.1 3,-0.3 0.735 103.2 53.2 -80.2 -18.8 13.6 4.7 41.4 179 187 A D G <> S+ 0 0 14 -3,-1.6 4,-2.7 1,-0.2 5,-0.3 0.389 75.8 104.9 -94.0 6.0 14.3 3.6 37.8 180 188 A K H <> S+ 0 0 120 -3,-0.7 4,-2.4 -4,-0.3 -1,-0.2 0.915 83.5 43.2 -52.4 -49.9 16.1 6.9 36.8 181 189 A Q H > S+ 0 0 143 -3,-0.3 4,-2.6 -4,-0.2 5,-0.2 0.978 116.8 45.0 -59.1 -59.1 19.6 5.3 36.8 182 190 A K H > S+ 0 0 81 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.811 115.0 49.7 -56.3 -33.3 18.6 2.1 35.1 183 191 A Y H X S+ 0 0 9 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.896 109.2 51.9 -74.6 -38.1 16.6 4.1 32.5 184 192 A N H X S+ 0 0 80 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.949 112.7 44.6 -60.2 -51.6 19.5 6.4 31.9 185 193 A Y H X S+ 0 0 101 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.959 113.5 50.1 -57.8 -54.1 21.9 3.6 31.3 186 194 A F H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.901 109.7 50.8 -52.4 -49.6 19.4 1.7 29.0 187 195 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.910 112.0 46.3 -55.1 -49.6 18.7 4.8 26.9 188 196 A M H X S+ 0 0 66 -4,-2.1 4,-1.6 2,-0.2 6,-0.2 0.936 114.6 46.9 -62.4 -47.8 22.4 5.5 26.3 189 197 A K H <>S+ 0 0 39 -4,-2.7 5,-2.5 1,-0.2 -2,-0.2 0.896 113.7 48.9 -63.1 -39.0 23.2 1.9 25.4 190 198 A W H ><5S+ 0 0 12 -4,-2.9 3,-1.4 -5,-0.3 -1,-0.2 0.898 109.5 49.1 -68.8 -41.8 20.2 1.6 23.1 191 199 A V H 3<5S+ 0 0 27 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.830 111.8 50.7 -68.7 -27.5 20.8 4.8 21.1 192 200 A N T 3<5S- 0 0 95 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.328 112.1-123.1 -87.2 3.9 24.4 3.8 20.6 193 201 A K T < 5 + 0 0 133 -3,-1.4 2,-1.6 1,-0.2 3,-0.3 0.779 62.0 147.4 59.3 27.8 23.3 0.4 19.4 194 202 A E > < + 0 0 38 -5,-2.5 3,-1.1 1,-0.2 4,-0.3 -0.481 13.3 157.0 -90.3 63.6 25.3 -1.4 22.1 195 203 A Y G >> + 0 0 45 -2,-1.6 4,-2.3 1,-0.2 3,-2.2 0.871 60.0 63.3 -58.5 -43.2 22.7 -4.1 22.3 196 204 A K G 34 S+ 0 0 167 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.712 95.5 61.3 -58.3 -21.3 25.0 -6.8 23.7 197 205 A K G <4 S+ 0 0 122 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.596 120.2 22.7 -84.0 -6.4 25.5 -4.7 26.9 198 206 A I T <4 S+ 0 0 8 -3,-2.2 2,-0.4 1,-0.3 -2,-0.2 0.481 124.6 41.2-131.7 -13.7 21.7 -4.8 27.7 199 207 A F < - 0 0 7 -4,-2.3 -1,-0.3 4,-0.0 2,-0.1 -0.992 64.6-138.8-144.1 135.3 20.3 -7.8 25.9 200 208 A T > - 0 0 76 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.456 47.7 -97.8 -77.8 164.1 21.5 -11.4 25.3 201 209 A K H > S+ 0 0 160 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.895 125.8 43.1 -54.2 -42.5 20.7 -12.5 21.8 202 210 A N H > S+ 0 0 118 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.889 111.9 52.4 -71.8 -37.3 17.6 -14.3 22.8 203 211 A Q H > S+ 0 0 39 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.934 108.2 53.5 -62.1 -44.0 16.4 -11.5 25.2 204 212 A F H X S+ 0 0 34 -4,-2.9 4,-2.2 2,-0.2 5,-0.2 0.960 110.6 44.9 -54.1 -58.0 16.8 -9.0 22.4 205 213 A N H X S+ 0 0 73 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.937 113.5 48.4 -52.6 -56.4 14.6 -11.0 19.9 206 214 A N H X S+ 0 0 94 -4,-2.4 4,-3.4 1,-0.2 -1,-0.2 0.891 110.4 53.6 -53.0 -42.2 11.9 -11.8 22.5 207 215 A S H X S+ 0 0 1 -4,-2.6 4,-3.0 -5,-0.2 -1,-0.2 0.929 109.8 45.4 -61.5 -47.0 11.8 -8.1 23.5 208 216 A L H X>S+ 0 0 22 -4,-2.2 5,-3.2 2,-0.2 4,-0.9 0.912 116.5 46.4 -62.9 -42.8 11.3 -6.8 19.9 209 217 A K H ><5S+ 0 0 160 -4,-2.5 3,-1.1 3,-0.2 -2,-0.2 0.966 114.3 47.6 -61.7 -52.8 8.6 -9.4 19.2 210 218 A H H 3<5S+ 0 0 143 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.899 114.9 45.9 -55.3 -43.6 7.0 -8.7 22.5 211 219 A A H 3<5S- 0 0 17 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.601 111.9-123.7 -75.5 -11.7 7.1 -4.9 21.7 212 220 A G T <<5 + 0 0 43 -3,-1.1 2,-0.8 -4,-0.9 -3,-0.2 0.864 51.8 162.4 70.6 35.6 5.9 -5.6 18.2 213 221 A I < + 0 0 13 -5,-3.2 -1,-0.2 1,-0.2 3,-0.1 -0.804 13.4 161.6 -93.4 106.3 8.9 -3.9 16.6 214 222 A D S S+ 0 0 152 -2,-0.8 2,-0.7 1,-0.2 -1,-0.2 0.888 71.8 47.2 -85.6 -45.9 9.3 -4.9 13.0 215 223 A D > - 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